SCHEMBL2933196

SCHEMBL2933196

COC(=O)/C=C/c1cccc(O)c1O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IAPP P10997 4/20 0.67
ALOX5 P09917 1/20 0.57
MAPT P10636 4/20 0.57
ALDH1A1 P00352 2/20 0.57
KDM4E B2RXH2 2/20 0.57
MEN1 O00255 1/20 0.57
TP53 P04637 1/20 0.57
CYP1A2 P05177 1/20 0.57
CYP2C9 P11712 1/20 0.57
HPGD P15428 1/20 0.57
ALOX15 P16050 1/20 0.57
CYP2C19 P33261 1/20 0.57
KMT2A Q03164 1/20 0.57
HSD17B10 Q99714 1/20 0.57
RELA Q04206 1/20 0.51
BACE1 P56817 1/20 0.51
NR1H4 Q96RI1 1/20 0.51
TTR P02766 1/20 0.50
APP P05067 1/20 0.50
CA12 O43570 1/20 0.50

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2933198 1.00 IAPP (0.67) IAPPALOX5MAPTALDH1A1KDM4E
SCHEMBL63054 0.86 MAPT (0.65) MAPTALDH1A1KDM4EMEN1TP53
SCHEMBL63055 0.86 MAPT (0.65) MAPTALDH1A1KDM4EMEN1TP53
SCHEMBL29362833 0.86 MAPT (0.65) MAPTALDH1A1KDM4EMEN1TP53
SCHEMBL7108533 0.85 MAPT (0.55) IAPPALOX5MAPTALDH1A1KDM4E
SCHEMBL7108530 0.85 MAPT (0.55) IAPPALOX5MAPTALDH1A1KDM4E
SCHEMBL11214993 0.83 ALDH1A1 (0.50) IAPPALOX5MAPTALDH1A1KDM4E
SCHEMBL11214996 0.83 ALDH1A1 (0.50) IAPPALOX5MAPTALDH1A1KDM4E
SCHEMBL10438847 0.81 ALDH1A1 (0.58) MAPTALDH1A1KDM4EMEN1TP53
SCHEMBL69522 0.81 ALDH1A1 (0.58) MAPTALDH1A1KDM4EMEN1TP53

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2230312-A1 Probe compound for detecting and isolating enzymes and means and methods using the same Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2010-09-22 EP disclosed
EP-0809493-B1 A METHOD FOR THE TREATMENT OF HYPERPROLIFERATIVE EPITHELIAL SKIN DISEASES BY TOPICAL APPLICATION OF HYDROXYLATED AROMATIC PROTEIN CROSS-LINKING COMPOUNDS US HEALTH (US) 2002-09-11 EP disclosed
EP-0809493-A1 A METHOD FOR THE TREATMENT OF HYPERPROLIFERATIVE EPITHELIAL SKIN DISEASES BY TOPICAL APPLICATION OF HYDROXYLATED AROMATIC PROTEIN CROSS-LINKING COMPOUNDS THE UNITED STATES GOVERNMENT as represented by THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1997-12-03 EP disclosed
US-5610185-A Method for the treatment of hyperproliferative epithelial skin diseases by topical application of hydroxylated aromatic protein cross-linking compounds THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1997-03-11 US disclosed
WO-1996025159-A1 A METHOD FOR THE TREATMENT OF HYPERPROLIFERATIVE EPITHELIAL SKIN DISEASES BY TOPICAL APPLICATION OF HYDROXYLATED AROMATIC PROTEIN CROSS-LINKING COMPOUNDS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1996-08-22 WO disclosed